3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide

C17H16N2O3 — CID 29260677

IUPAC3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C17H16N2O3/c20-15-7-2-1-6-14(15)19-17(22)12-4-3-5-13(10-12)18-16(21)11-8-9-11/h1-7,10-11,20H,8-9H2,(H,18,21)(H,19,22)
InChIKeyNZGOZOKPSLCYGU-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.99
Rot. Bonds4

About 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide

3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide (PubChem CID 29260677) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide.

Molecular Properties

Compound Name3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide
PubChem CID29260677
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide
SMILESO=C(Nc1ccccc1O)c1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C17H16N2O3/c20-15-7-2-1-6-14(15)19-17(22)12-4-3-5-13(10-12)18-16(21)11-8-9-11/h1-7,10-11,20H,8-9H2,(H,18,21)(H,19,22)
InChIKeyNZGOZOKPSLCYGU-UHFFFAOYSA-N
XLogP2.99
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-chlorophenoxy)phenyl]-3-(cyclopropanecarbonylamino)benzamide
CID 31801212
N-(3-bromophenyl)-3-(cyclopropanecarbonylamino)benzamide
CID 35436954
1-N,4-N-bis[3-(methylcarbamoyl)phenyl]cyclohexane-1,4-dicarboxamide
CID 17233453
3-(cyclopropanecarbonylamino)-N-[3-(cyclopropylcarbamoyl)phenyl]benzamide
CID 30127139
N-(2-acetylphenyl)-3-(cyclohexanecarbonylamino)benzamide
CID 55666415
N-[4-(cyclohexanecarbonylamino)-2-hydroxyphenyl]benzamide
CID 17363024
N-[4-(carbamoylamino)phenyl]-3-(cyclopropanecarbonylamino)benzamide
CID 33151643
3-(cyclopropanecarbonylamino)-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide
CID 51337522
3-(cyclopropanecarbonylamino)-N-(4-phenoxyphenyl)benzamide
CID 34757379
5-bromo-2-[[3-(cyclopropanecarbonylamino)benzoyl]amino]benzoic acid
CID 17018719
N-(5-chloro-2,4-dimethoxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
CID 36542869
2-[[3-(cyclopropanecarbonylamino)benzoyl]amino]-5-methylbenzoic acid
CID 17172311

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide?
The IUPAC name of 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide (CID 29260677) is 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide.
What is the SMILES notation for 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide?
The canonical SMILES for 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide is O=C(Nc1ccccc1O)c1cccc(NC(=O)C2CC2)c1.
What is the InChIKey of 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide?
The InChIKey is NZGOZOKPSLCYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O3/c20-15-7-2-1-6-14(15)19-17(22)12-4-3-5-13(10-12)18-16(21)11-8-9-11/h1-7,10-11,20H,8-9H2,(H,18,21)(H,19,22).
What are the key properties of 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide?
3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide has a molecular weight of 296.33 g/mol, XLogP of 2.99, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropanecarbonylamino)-N-(2-hydroxyphenyl)benzamide is sourced from PubChem (CID 29260677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).